N-[(4-fluorophenyl)methyl]-5-[[(3-methoxyphenyl)carbonyl-phenethyl-amino]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-5-[[(3-methoxyphenyl)carbonyl-phenethyl-amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-[(4-fluorophenyl)methyl]-5-[[(3-methoxybenzoyl)-phenethyl-amino]methyl]isoxazole-3-carboxamide CAS Name: N-[(4-fluorophenyl)methyl]-5-[[[(3-methoxyphenyl)-oxomethyl]-phenethylamino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-[(4-fluorophenyl)methyl]-5-[[(3-methoxybenzoyl)-phenethylamino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: N-(4-fluorobenzyl)-5-[[m-anisoyl(phenethyl)amino]methyl]isoxazole-3-carboxamide Formula: C28H26FN3O4 MolecularWeight: 487.522143

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N(CCC2=CC=CC=C2)CC3=CC(=NO3)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N(CCC2=CC=CC=C2)CC3=CC(=NO3)C(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C28H26FN3O4/c1-35-24-9-5-8-22(16-24)28(34)32(15-14-20-6-3-2-4-7-20)19-25-17-26(31-36-25)27(33)30-18-21-10-12-23(29)13-11-21/h2-13,16-17H,14-15,18-19H2,1H3,(H,30,33)